SCHEMBL27373

SCHEMBL27373

O=COCCCc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ IDO1 P14902 1/20 0.55
▸ LMNA P02545 1/20 0.52
▸ SIGMAR1 Q99720 5/20 0.48
▸ SMN1; SMN2 Q16637 2/20 0.46
▸ FFAR1 O14842 1/20 0.46
▸ NPC1 O15118 1/20 0.46
▸ RECQL P46063 1/20 0.46
▸ RAB9A P51151 1/20 0.46
▸ DRD2 P14416 1/20 0.46
▸ DRD4 P21917 1/20 0.46
▸ DRD3 P35462 1/20 0.46
▸ HDAC3 O15379 1/20 0.45
▸ MAPK1 P28482 1/20 0.45
▸ ADRA1A P35348 1/20 0.45
▸ HDAC4 P56524 1/20 0.45
▸ SLC6A3 Q01959 1/20 0.45
▸ HDAC1 Q13547 1/20 0.45
▸ HDAC7 Q8WUI4 1/20 0.45
▸ HDAC2 Q92769 1/20 0.45
▸ HDAC10 Q969S8 1/20 0.45

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2517 0.94 SIGMAR1 (0.48) IDO1LMNASIGMAR1FFAR1DRD2
SCHEMBL99522 0.93 MEN1 (0.49) IDO1LMNASIGMAR1SMN1; SMN2FFAR1
SCHEMBL5544962 0.93 MEN1 (0.49) IDO1LMNASIGMAR1SMN1; SMN2FFAR1
SCHEMBL97332 0.92 SIGMAR1 (0.52) IDO1SIGMAR1FFAR1
SCHEMBL96962 0.92 SIGMAR1 (0.52) IDO1SIGMAR1FFAR1
SCHEMBL5537364 0.91 MEN1 (0.47) IDO1LMNASIGMAR1
SCHEMBL5542421 0.91 MEN1 (0.47) IDO1LMNASIGMAR1
SCHEMBL5543316 0.89 MEN1 (0.49) IDO1LMNASIGMAR1SMN1; SMN2FFAR1
SCHEMBL5542777 0.89 FFAR1 (0.46) IDO1LMNAFFAR1HDAC1HDAC2
SCHEMBL97490 0.89 TDP1 (0.46) IDO1LMNASIGMAR1FFAR1MAOA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1085 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4482306-A1 VOLATILE HDAC INHIBITORS FOR THERAPEUTIC AND PLANT APPLICATIONS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2025-01-01 — — EP claimed
WO-2024112705-A1 BORONIC ACID AND BORONATE COMPOSITIONS AND METHODS ELIMA THERAPEUTICS, INC. (US) 2024-05-30 — — WO claimed
WO-2023192424-A1 VOLATILE HD AC INHIBITORS FOR THERAPEUTIC AND PLANT APPLICATIONS CROSS-REFERENCE TO RELATED APPLICATION THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2023-10-05 — — WO claimed
CN-108514559-A Oral liquid containing orlistat and calcium supplement organic acid calcium eutectic 中山万汉制药有限公司 2018-09-11 — — CN claimed
EP-2758389-B1 PYRAZOLE CARBOXAMIDES AS JANUS KINASE INHIBITORS MERCK SHARP & DOHME (US) 2017-06-07 — — EP claimed
CN-106074560-A The application of Fructus Rubi extract 江西中医药大学 2016-11-09 — — CN claimed
US-9394282-B2 Pyrazole carboxamides as Janus kinase inhibitors MERCK SHARP & DOHME CORP. (US) 2016-07-19 — — US claimed
US-20140235641-A1 PYRAZOLE CARBOXAMIDES AS JANUS KINASE INHIBITORS INTERVET INC. 2014-08-21 — — US claimed
CN-103405486-A Chrysanthemum flower formula granules, and preparation method and quality control method thereof ANHUI JIREN PHARMACEUTICAL CO LTD 2013-11-27 — — CN claimed
CN-103405505-A Mulberry bark formula granules, and preparation method and quality control method thereof ANHUI JIREN PHARMACEUTICAL CO LTD 2013-11-27 — — CN claimed
CN-1178912-C Small molecule inhibitors of rotamase enzyme activity ������˹ҩƷ��˾ 2004-12-08 — — CN claimed
US-6762180-B1 Substituted indolines which inhibit receptor tyrosine kinases BOEHRINGER INGELHEIM PHARMA KG (DE) 2004-07-13 — — US claimed
EP-1206446-B1 CARBOXYLIC ACID AMIDES, THEIR PRODUCTION AND THEIR USE AS DRUGS BOEHRINGER INGELHEIM PHARMA (DE) 2004-05-26 — — EP claimed
US-20040068122-A1 Delta1-pyrrolines used as pesticides BAYER CROPSCIENCE AG (DE) 2004-04-08 — — US claimed
WO-2004013086-A1 PHOTOACTIVE MATERIALS ROLIC AG (CH) 2004-02-12 — — WO claimed
EP-1386910-A1 Photoactive materials Rolic AG (CH) 2004-02-04 — — EP claimed
EP-1322608-A1 DELTA1-PYRROLINES USED AS PESTICIDES Bayer CropScience AG (DE) 2003-07-02 — — EP claimed
CN-1422851-A Substituted five-membered nitrogen heterocyclic compound and application thereof in preventing and treating neurodegenerative diseases TOXICANT AND MEDICINE INST MIL (CN) 2003-06-11 — — CN claimed
WO-2002024646-A1 DELTA1-PYRROLINES USED AS PESTICIDES BAYER CROPSCIENCE AG (DE) 2002-03-28 — — WO claimed
CN-1187188-A Small molecule inhibitors of rotamase enzyme activity GUILFORD PHARM INC (US) 1998-07-08 — — CN claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040068122-A1 Delta1-pyrrolines used as pesticides DDT, ADRA1D, OPRD1 IDO1 342/4885LMNA 3251/4885SIGMAR1 449/4885
US-20140235641-A1 PYRAZOLE CARBOXAMIDES AS JANUS KINASE INHIBITORS JAK1, JAK3, JAK2 IDO1 239/4885LMNA 4840/4885SIGMAR1 2060/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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